Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.69 |
| ▸ | RAB9A | P51151 | 3/20 | 0.69 |
| ▸ | MAOA | P21397 | 2/20 | 0.61 |
| ▸ | MAOB | P27338 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | TERT | O14746 | 3/20 | 0.59 |
| ▸ | EGFR | P00533 | 2/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 3/20 | 0.56 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | CA2 | P00918 | 3/20 | 0.56 |
| ▸ | CA9 | Q16790 | 3/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27986738 | 0.89 | ACHE (0.64) | MAOBTERTACHEKDM4E | |
| SCHEMBL28414052 | 0.83 | CA12 (0.65) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL28409452 | 0.80 | CA12 (0.64) | NPC1RAB9AMAOAMAOBEGFR | |
| SCHEMBL27790823 | 0.76 | MAOA (1.00) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL23052167 | 0.76 | NPC1 (0.71) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL15436205 | 0.76 | MAOB (0.81) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL21440072 | 0.76 | MAOB (0.81) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL23052465 | 0.76 | NPC1 (0.71) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL28412233 | 0.73 | MAOA (0.77) | NPC1RAB9AMAOAMAOBMEN1 | |
| SCHEMBL3318038 | 0.73 | EGFR (0.76) | NPC1RAB9AMAOAMAOBMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103949219-A | Preparation method of porous composite material capable of selectively absorbing aromatic hydrocarbon | UNIV SOUTHEAST | 2014-07-30 | — | — | CN | disclosed |